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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H26F3N3O4
Molecular Weight 465.4654
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (5R)-4,5-DIHYDRO-5-METHYL-5-((4-(4-(4-(TRIFLUOROMETHOXY)PHENOXY)-1-PIPERIDINYL)PHENOXY)METHYL)-2-OXAZOLAMINE

SMILES

C[C@]4(COC1=CC=C(C=C1)N2CCC(CC2)OC3=CC=C(OC(F)(F)F)C=C3)CN=C(N)O4

InChI

InChIKey=YDAIKJSLITWSBP-JOCHJYFZSA-N
InChI=1S/C23H26F3N3O4/c1-22(14-28-21(27)33-22)15-30-17-4-2-16(3-5-17)29-12-10-19(11-13-29)31-18-6-8-20(9-7-18)32-23(24,25)26/h2-9,19H,10-15H2,1H3,(H2,27,28)/t22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H26F3N3O4
Molecular Weight 465.4654
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:17:36 GMT 2023
Edited
by admin
on Sat Dec 16 15:17:36 GMT 2023
Record UNII
Y569TM2AT2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(5R)-4,5-DIHYDRO-5-METHYL-5-((4-(4-(4-(TRIFLUOROMETHOXY)PHENOXY)-1-PIPERIDINYL)PHENOXY)METHYL)-2-OXAZOLAMINE
Systematic Name English
2-OXAZOLAMINE, 4,5-DIHYDRO-5-METHYL-5-((4-(4-(4-(TRIFLUOROMETHOXY)PHENOXY)-1-PIPERIDINYL)PHENOXY)METHYL)-, (5R)-
Systematic Name English
DELAMANID METABOLITE M1
Common Name English
Code System Code Type Description
CAS
1202875-92-0
Created by admin on Sat Dec 16 15:17:36 GMT 2023 , Edited by admin on Sat Dec 16 15:17:36 GMT 2023
PRIMARY
PUBCHEM
44511499
Created by admin on Sat Dec 16 15:17:36 GMT 2023 , Edited by admin on Sat Dec 16 15:17:36 GMT 2023
PRIMARY
FDA UNII
Y569TM2AT2
Created by admin on Sat Dec 16 15:17:36 GMT 2023 , Edited by admin on Sat Dec 16 15:17:36 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MAJOR
PLASMA